SCHEMBL18705149

SCHEMBL18705149

CC(C)N1CC2(CCCNC2)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 9/20 0.46
CYP3A4 P08684 9/20 0.46
ALDH1A1 P00352 8/20 0.46
USP2 O75604 5/20 0.46
CYP2C9 P11712 2/20 0.46
CYP1A2 P05177 6/20 0.39
HSD17B10 Q99714 5/20 0.38
TSHR P16473 3/20 0.38
MAPK1 P28482 4/20 0.36
CYP2C19 P33261 3/20 0.36
TP53 P04637 3/20 0.36
HPGD P15428 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALOX15 P16050 1/20 0.32
NAMPT P43490 1/20 0.31
SOS1 Q07889 1/20 0.31
SOS2 Q07890 1/20 0.31
KDM1A O60341 1/20 0.30
CHEK1 O14757 1/20 0.30
AURKA O14965 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17066203 0.88 TSHR (0.43) CYP2D6CYP3A4ALDH1A1USP2CYP2C9
SCHEMBL18975979 0.87 CYP3A4 (0.50) CYP2D6CYP3A4ALDH1A1USP2CYP2C9
SCHEMBL18482094 0.87 CYP3A4 (0.57) CYP2D6CYP3A4ALDH1A1USP2CYP2C9
SCHEMBL27275355 0.85 CYP3A4 (0.49) CYP2D6CYP3A4ALDH1A1USP2CYP2C9
SCHEMBL18463961 0.82 CYP2D6 (0.49) CYP2D6CYP3A4ALDH1A1USP2CYP2C9
SCHEMBL21217092 0.82 CYP2D6 (0.42) CYP2D6CYP3A4ALDH1A1USP2CYP2C9
SCHEMBL18705153 0.79 CYP2D6 (0.45) CYP2D6CYP3A4ALDH1A1USP2CYP2C9
SCHEMBL12371612 0.78 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL27275304 0.78 TSHR (0.44) CYP2D6CYP3A4ALDH1A1USP2CYP2C9
SCHEMBL27257210 0.78 CYP2D6 (0.40) CYP2D6CYP3A4ALDH1A1USP2CYP2C9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239811-A1 5-(5-(PIPERIDIN-4-YL)THIENO[3,2-C]PYRAZOL-2-YL]INDAZOLE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS FOR SPLICING NUCLEIC ACIDS AND FOR THE T REMIX THERAPEUTICS INC. 2024-07-18 US disclosed
US-20230365526-A1 PYRIDAZINE DERIVATIVES FOR MODULATING NUCLEIC ACID SPLICING REMIX THERAPEUTICS INC (US) 2023-11-16 US disclosed
US-20230365566-A1 HETEROCYCLIC AMIDES AND THEIR USE FOR MODULATING SPLICING REMIX THERAPEUTICS INC. 2023-11-16 US disclosed
WO-2023220137-A1 PYRAZINE DERIVATIVES AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2023-11-16 WO disclosed
US-11806346-B2 HTT modulators for treating Huntington's disease CHDI FOUNDATION, INC. (US) 2023-11-07 US disclosed
US-11806346-B2 HTT modulators for treating Huntington's disease CHDI FOUNDATION, INC. (US) 2023-11-07 US disclosed
US-20230219979-A1 PYRAZOLO[1,5-a]PYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF SHENZHEN ZHONGGE BIOLOGICAL TECHNOLOGY CO., LTD. (CN) 2023-07-13 US disclosed
US-20230203039-A1 MACROCYCLIC PAD4 INHIBITORS USEFUL AS IMMUNOSUPPRESSANT BRISTOL MYERS SQUIBB CO (US) 2023-06-29 US disclosed
US-20230203039-A1 MACROCYCLIC PAD4 INHIBITORS USEFUL AS IMMUNOSUPPRESSANT BRISTOL MYERS SQUIBB CO (US) 2023-06-29 US disclosed
US-20230167131-A1 HETEROCYCLIC PAD4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2023-06-01 US disclosed
US-20170369498-A1 TRICYCLIC GYRASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-12-28 US disclosed
US-9765093-B2 Aza-benzimidazole inhibitors of PAD4 PADLOCK THERAPEUTICS, INC. (US) 2017-09-19 US disclosed
US-9765093-B2 Aza-benzimidazole inhibitors of PAD4 PADLOCK THERAPEUTICS, INC. (US) 2017-09-19 US disclosed
US-20170190713-A1 FUSED QUADRACYCLIC COMPOUNDS, COMPOSITIONS AND USES THEREOF WUXI APPTEC (HONG KONG) CO., LIMITED (HK) 2017-07-06 US disclosed
US-20170166565-A1 BICYCLIC INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. 2017-06-15 US disclosed
US-20170166565-A1 BICYCLIC INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. 2017-06-15 US disclosed
US-20170166592-A1 AZA-BENZIMIDAZOLE INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. 2017-06-15 US disclosed
US-20170166592-A1 AZA-BENZIMIDAZOLE INHIBITORS OF PAD4 PADLOCK THERAPEUTICS, INC. 2017-06-15 US disclosed
US-20170096425-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2017-04-06 US disclosed
US-20170096425-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2017-04-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230365566-A1 HETEROCYCLIC AMIDES AND THEIR USE FOR MODULATING SPLICING RBM17, HNRNPA1, HNRNPAB CYP2D6 2418/4885CYP3A4 2577/4885ALDH1A1 1569/4885
US-20170096425-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF CYP2D6 3133/4885CYP3A4 2929/4885ALDH1A1 2706/4885
US-20230219979-A1 PYRAZOLO[1,5-a]PYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF RET, GRK4, RIN1 CYP2D6 3101/4885CYP3A4 1590/4885ALDH1A1 1772/4885
US-20230203039-A1 MACROCYCLIC PAD4 INHIBITORS USEFUL AS IMMUNOSUPPRESSANT PADI4, PADI1, PADI2 CYP2D6 429/4885CYP3A4 85/4885ALDH1A1 142/4885
US-11806346-B2 HTT modulators for treating Huntington's disease HTT, HYPK, ATXN2 CYP2D6 4594/4885CYP3A4 4809/4885ALDH1A1 4119/4885
US-20170369498-A1 TRICYCLIC GYRASE INHIBITORS TOP1, TOP2A, TOP2B CYP2D6 84/4885CYP3A4 129/4885ALDH1A1 1898/4885
US-20230365526-A1 PYRIDAZINE DERIVATIVES FOR MODULATING NUCLEIC ACID SPLICING SNRPA, RBM17, SNRPB2 CYP2D6 2823/4885CYP3A4 3036/4885ALDH1A1 3247/4885
US-20170190713-A1 FUSED QUADRACYCLIC COMPOUNDS, COMPOSITIONS AND USES THEREOF MKNK2, CYP2J2, PTGS2 CYP2D6 562/4885CYP3A4 790/4885ALDH1A1 4091/4885
US-20170166565-A1 BICYCLIC INHIBITORS OF PAD4 PADI4, PADI1, PADI2 CYP2D6 3038/4885CYP3A4 1363/4885ALDH1A1 955/4885
US-20170166592-A1 AZA-BENZIMIDAZOLE INHIBITORS OF PAD4 PADI4, PADI1, PADI6 CYP2D6 2181/4885CYP3A4 530/4885ALDH1A1 359/4885
US-20230167131-A1 HETEROCYCLIC PAD4 INHIBITORS PADI4, PADI2, PADI6 CYP2D6 460/4885CYP3A4 233/4885ALDH1A1 104/4885
US-20240239811-A1 5-(5-(PIPERIDIN-4-YL)THIENO[3,2-C]PYRAZOL-2-YL]INDAZOLE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS FOR SPLICING NUCLEIC ACIDS AND FOR THE T HNRNPAB, HNRNPC, HNRNPA1 CYP2D6 4118/4885CYP3A4 3740/4885ALDH1A1 959/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.